NP-MRD: Browsing natural products

NP-MRD ID
CAS Number Compound Name Species of Origin Chemical Structure Chemical Formula
Average Mass
Monoisotopic Mass NMR Spectra

NP0350599

Otitiglycomycin B

Not Available

C₂₄H₄₄O₁₀

492.6060 Da
492.29345 Da

¹³C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
¹H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)
¹H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)

NP0350598

Otitiglycomycin A

Not Available

C₃₁H₅₆O₁₁

604.7780 Da
604.38226 Da

¹³C NMR Spectrum (1D, 126 MHz, CD3OD, experimental)
¹H NMR Spectrum (1D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, CD3OD, experimental)

NP0350597

PcTS1diterpene-5

Not Available

C₂₀H₃₁F

290.4660 Da
290.24098 Da

¹H NMR Spectrum (1D, 600 MHz, C6D6, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C6D6, experimental)
¹H NMR Spectrum (1D, 600 MHz, C6D6, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C6D6, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C6D6, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C6D6, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C6D6, experimental)
¹⁹F NMR Spectrum (1D, 565 MHz, C6D6, experimental)

NP0350596

PcTS1diterpene-4

Not Available

C₂₀H₃₂

274.4880 Da
274.26295 Da

¹H NMR Spectrum (1D, 600 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 151 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, CDCl3, experimental)

NP0350590

sealgamide

Not Available

C₇₅H₁₂₂N₁₂O₁₈

1479.8670 Da
1478.90001 Da

[¹H, ¹H] NMR Spectrum (2D, 396 MHz, CD3CN, experimental)
¹H NMR Spectrum (1D, 396 MHz, CD3CN, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 392 MHz, CD3CN, experimental)
¹³C NMR Spectrum (1D, 100 MHz, CD3CN, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 392 MHz, CD3CN, experimental)
[¹H, ¹H] NMR Spectrum (2D, 392 MHz, CD3CN, experimental)
[¹H, ¹H] NMR Spectrum (2D, 396 MHz, CD3CN, experimental)

NP0350589

Gymnopeptide D

Not Available

C₈₈H₁₅₆N₁₈O₂₀

1786.3220 Da
1785.17433 Da

¹³C NMR Spectrum (1D, 201 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 800 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)
[¹H, ¹⁵N] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)

NP0350588

Gymnopeptide C

Not Available

C₈₇H₁₅₄N₁₈O₁₉

1756.2960 Da
1755.16376 Da

¹³C NMR Spectrum (1D, 201 MHz, CDCl3, experimental)
¹H NMR Spectrum (1D, 800 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)
[¹H, ¹⁵N] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 800 MHz, CDCl3, experimental)

NP0350587

20(27)-octanorcycloartan-3,6,16-trione

Not Available

C₂₂H₃₀O₃

342.4790 Da
342.21949 Da

¹H NMR Spectrum (1D, 400, C₅D₅N, simulated)
¹³C NMR Spectrum (1D, 101 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 400 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)

NP0350586

20(27)-octanorcycloartan-1-en-3,6,16-trione

Not Available

C₂₂H₂₈O₃

340.4630 Da
340.20384 Da

¹H NMR Spectrum (1D, 500, C₅D₅N, simulated)
¹³C NMR Spectrum (1D, 126 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 500 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 500 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 500 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C5D5N, experimental)

NP0350585

Astracondensatol E

Not Available

C₃₀H₄₈O₆

504.7080 Da
504.34509 Da

¹H NMR Spectrum (1D, 400, C₅D₅N, simulated)
¹³C NMR Spectrum (1D, 101 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 400 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 400 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 400 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)

NP0350584

Astracondensatol D

Not Available

C₃₀H₄₆O₅

486.6930 Da
486.33452 Da

¹H NMR Spectrum (1D, 500, C₅D₅N, simulated)
¹³C NMR Spectrum (1D, 126 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 500 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 500 MHz, C5D5N, experimental)
¹H NMR Spectrum (1D, 500 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C5D5N, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 500 MHz, C5D5N, experimental)
[¹H, ¹H] NMR Spectrum (2D, 500 MHz, C5D5N, experimental)

NP0350583

Guanacastepene U

Not Available

C₂₀H₂₆O₄

330.4240 Da
330.18311 Da

¹H NMR Spectrum (1D, 400.3424721, C2D6OS, simulated)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 400 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 101 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, C2D6OS, experimental)

NP0350582

phomoparagins F

Not Available

C₂₈H₃₇NO₃

435.6080 Da
435.27734 Da

¹H NMR Spectrum (1D, 700 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 176 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 176 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, CDCl3, experimental)

NP0350581

phomoparagins E

Not Available

C₂₈H₃₇NO₃

435.6080 Da
435.27734 Da

¹H NMR Spectrum (1D, 700 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 176 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 176 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, CDCl3, experimental)

NP0350580

phomoparagins D

Not Available

C₂₈H₃₅NO₃

433.5920 Da
433.26169 Da

[¹H, ¹H] NMR Spectrum (2D, 700 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 700 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, CD3OD, experimental)
[¹H, ¹H] NMR Spectrum (2D, 700 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, CD3OD, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 700 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 176 MHz, CD3OD, experimental)
¹³C NMR Spectrum (1D, 176 MHz, CD3OD, experimental)

NP0350578

6-C-β-L-[2-O-(α-L-rhamnopyranosyl)-fucopyranosyl]-7-O-methyl-apigenin

Not Available

C₂₈H₃₂O₁₃

576.5510 Da
576.18429 Da

¹H NMR Spectrum (1D, 600, C2D6OS, simulated)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0350577

6-C-β-L-[6-deoxy-2-O-(α-L-rhamnopyranosyl)-ribo-hexos-3-ulopyranosyl]-7-O-methyl-apigenin

Not Available

C₂₈H₃₀O₁₃

574.5350 Da
574.16864 Da

¹H NMR Spectrum (1D, 600, C2D6OS, simulated)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0350576

6-C-(3,5-dihydroxy-6-methyl-γ-pyrone-2-yl)-7-O-methyl-apigenin

Not Available

C₂₂H₁₆O₉

424.3610 Da
424.07943 Da

¹H NMR Spectrum (1D, 600, C2D6OS, simulated)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0350575

6-trans-[2"-O-(α-L-rhamnopyranosyl)]-ethenyl-7-O-methyl-apigenin

Not Available

C₂₄H₂₄O₁₀

472.4460 Da
472.13695 Da

¹H NMR Spectrum (1D, 600, C2D6OS, simulated)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0350574

6-C-(2-methoxy-2-oxoethyl)-apigenin

Not Available

C₁₈H₁₄O₇

342.3030 Da
342.07395 Da

¹H NMR Spectrum (1D, 600, C2D6OS, simulated)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0350573

6-C-β-L-oliofuranosly-7-O-methyl-apigenin

Not Available

C₂₂H₂₂O₈

414.4100 Da
414.13147 Da

¹H NMR Spectrum (1D, 600, C2D6OS, simulated)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0350572

6-C-β-D-oliopyranosyl-7-O-methyl-apigenin

Not Available

C₂₂H₂₂O₈

414.4100 Da
414.13147 Da

¹H NMR Spectrum (1D, 600, C2D6OS, simulated)
¹³C NMR Spectrum (1D, 151 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0350571

6-C-β-D-olivopyranosyl-7-O-methyl-apigenin

Not Available

C₂₂H₂₂O₈

414.4100 Da
414.13147 Da

¹H NMR Spectrum (1D, 500, C2D6OS, simulated)
¹³C NMR Spectrum (1D, 126 MHz, C2D6OS, experimental)
¹H NMR Spectrum (1D, 500 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)
[¹H, ¹H] NMR Spectrum (2D, 600 MHz, C2D6OS, experimental)

NP0350570

(3R*,4S*)-2,2-Dimethyl-3,4,6-trihydroxychromane

Not Available

C₁₁H₁₄O₄

210.2290 Da
210.08921 Da

¹H NMR Spectrum (1D, 400 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, C3D6O, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, C3D6O, experimental)
¹³C NMR Spectrum (1D, 101 MHz, C3D6O, experimental)
¹³C NMR Spectrum (1D, 101 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, C3D6O, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, C3D6O, experimental)

NP0350569

3,7-Dihydroxy-2,2-dimethyl-6-methoxychromane

Not Available

C₁₂H₁₆O₄

224.2560 Da
224.10486 Da

¹H NMR Spectrum (1D, 400 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)
[¹H, ¹H] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
¹³C NMR Spectrum (1D, 101 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, CDCl3, experimental)
[¹H, ¹³C] NMR Spectrum (2D, 400 MHz, D2O, experimental)

Browsing natural products

Filter by kingdom:

Filter by solvent:

Filter by spectral type:

Filter by nucleus:

Filter by spectra quality:

Filter by assignment quality: